Summary

IMPPAT Phytochemical identifier: IMPHY017494

Phytochemical name: 6-Hepten-1-ol, 2-methyl-

Synonymous chemical names:
6-hepten-1-ol, 2-methyl

External chemical identifiers:
CID:565262, SureChEMBL:SCHEMBL3447384

---

Chemical structure information

SMILES:
C=CCCCC(CO)C

InChI:
InChI=1S/C8H16O/c1-3-4-5-6-8(2)7-9/h3,8-9H,1,4-7H2,2H3

InChIKey:
UVGLIWCAMUOQPL-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCO))C

Functional groups:
C=CC, CO

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.294

---

Chemical structure download